Cas no 22156-68-9 (Benzeneacetonitrile,4-amino-a-methyl-a-phenyl-)

Benzeneacetonitrile,4-amino-a-methyl-a-phenyl- structure
22156-68-9 structure
Product Name:Benzeneacetonitrile,4-amino-a-methyl-a-phenyl-
CAS No:22156-68-9
MF:C15H14N2
MW:222.285063266754
CID:282329
PubChem ID:211060
Update Time:2025-04-19

Benzeneacetonitrile,4-amino-a-methyl-a-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetonitrile,4-amino-a-methyl-a-phenyl-
    • 2-(4-aminophenyl)-2-phenylpropanenitrile
    • 22156-68-9
    • Propionitrile, 2-(p-aminophenyl)-2-phenyl-
    • BRN 2728615
    • SCHEMBL2817460
    • 2-(p-Aminophenyl)-2-phenylpropionitrile
    • A817748
    • 2-(4-aminophenyl)-2-phenyl-propanenitrile
    • FXDPMMRRRJRSLY-UHFFFAOYSA-N
    • 2-(4-Amino-phenyl)-2-phenyl-propionitrile
    • DTXSID90944803
    • Inchi: 1S/C15H14N2/c1-15(11-16,12-5-3-2-4-6-12)13-7-9-14(17)10-8-13/h2-10H,17H2,1H3
    • InChI Key: FXDPMMRRRJRSLY-UHFFFAOYSA-N
    • SMILES: NC1C=CC(=CC=1)C(C#N)(C)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 222.11582
  • Monoisotopic Mass: 222.115698455g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 289
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 49.8?2

Experimental Properties

  • PSA: 49.81
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